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Experiments 103 - 120 as of March 19, 2014

Experiment Status Navigation

1 - 18 / 19 - 38 / 39 - 71 / 72 - 102 / 103 - 120 / 121 - 166

Corresponding Batches
1-3702 / 4000-26810 / 26811-97214 / 97215-281070 / 281071-552394 / 552395-908573
Happy new year! Since February 2014, some FightAIDS@Home experiments have been using AutoDock Flexible Vina.

Note: one AutoDock "batch" involves docking ~1,000 compounds, while one AD Vina batch involves docking ~10,000 compounds.
Experiments 115-120: 0% completed

Experiments 115 to 120 (AD Vina), 79% completed

Experiments 115 through 120 target the active site of HIV protease. These experiments involve screening 6 libraries (Full NCI, Enamine, ChemBridge, Asinex, Vitas-M and Maybridge). These experiments will help distinguish better sites of among a group of receptor structures even within the same structure. Potentially important molecules (in these cases: water and/or chloride ion) found in the original structures are left in different combinations to produce varied models for HIV protease.



TARGET: active site of PR
AD Exp. 115
AD Vina Exp. 61
AD Exp. 116
AD Vina Exp. 62
AD Exp. 117
AD Vina Exp. 63
AD Exp. 118
AD Vina Exp. 64
AD Exp. 119
AD Vina Exp. 65
AD Exp. 120
AD Vina Exp. 66
Receptor StructureFull NCIEnamineChemBridgeAsinexVitas-MMaybridge
PDB 1ZTZ, Active Site396767-396798405326-405560468641-468742496019-496069509708-509858550316-550323
PDB 3I8Wa, Active Site396799-396830405561-405795468743-468844496070-496120509859-510009550324-550331
PDB 3I8Wb, Active Site396831-396862405796-406030468845-468946496121-496171510010-510160550332-550339
PDB 3KF0, Active Site396863-396894406031-406265468947-469048496172-496222510161-510311550340-550347
PDB 3KF0 with water, Active Site396895-396926406266-406500469049-469150496223-496273510312-510462550348-550355
PDB 3KFN, Active Site396927-396958406501-406735469151-469252496274-496324510463-510613550356-550363
PDB 3KFN with water, Active Site396959-396990406736-406970469253-469354496325-496375510614-510764550364-550371
PDB 3KFP, Active Site396991-397022406971-407205469355-469456496376-496426510765-510915550372-550379
PDB 3KFP with water, Active Site397023-397054407206-407440469457-469558496427-496477510916-511066550380-550387
PDB 3KFR, Active Site397055-397086407441-407675469559-469660496478-496528511067-511217550388-550395
PDB 3KFR with water, Active Site397087-397118407676-407910469661-469762496529-496579511218-511368550396-550403
PDB 3KFS, Active Site397119-397150407911-408145469763-469864496580-496630511369-511519550404-550411
PDB 3KFS with water, Active Site397151-397182408146-408380469865-469966496631-496681511520-511670550412-550419
PDB 3T11a, Active Site397183-397214408381-408615469967-470068496682-496732511671-511821550420-550427
PDB 3T11a with chloride, Active Site397215-397246408616-408850470069-470170496733-496783511822-511972550428-550435
PDB 3T11a with water, Active Site397247-397278408851-409085470171-470272496784-496834511973-512123550436-550443
PDB 3T11a with chloride and water, Active Site397279-397310409086-409320470273-470374496835-496885512124-512274550444-550451
PDB 3T11b, Active Site397311-397342409321-409555470375-470476496886-496936512275-512425550452-550459
PDB 3T11b with chloride, Active Site397343-397374409556-409790470477-470578496937-496987512426-512576550460-550467
PDB 3T11b with water, Active Site397375-397406409791-410025470579-470680496988-497038512577-512727550468-550475
PDB 3T11b with chloride and water, Active Site397407-397438410026-410260470681-470782497039-497089512728-512878550476-550483
PDB 4DQG, Active Site397439-397470410261-410495470783-470884497090-497140512879-513029550484-550491
PDB 4DQG with water, Active Site397471-397502410496-410730470885-470986497141-497191513030-513180550492-550499
PDB 4E43a, Active Site397503-397534410731-410965470987-471088497192-497242513181-513331550500-550507
PDB 4E43a with water, Active Site397535-397566410966-411200471089-471190497243-497293513332-513482550508-550515
PDB 4E43b, Active Site397567-397598411201-411435471191-471292497294-497344513483-513633550516-550523
PDB 4E43b with water, Active Site397599-397630411436-411670471293-471394497345-497395513634-513784550524-550531
COMPLETION13%67%99.7%100%99.9%95.8%

Experiments 109-114: 68% completed

Experiments 109 to 114 (AutoDock), 68% completed

Experiments 109 through 114 target the LEDGF site of HIV integrase. These experiments involve screening 6 libraries (Full NCI, Enamine, ChemBridge, Asinex, Vitas-M and Maybridge). These experiments will help distinguish better sites of among a group of receptor structures even within the same structure. To help read structures in the table below, the "a" and "b" after the 4-character PDB ID designate those receptor structures with alternate residue positions, while the "a" and "b" with the sites (FBP, LEDGF, Y3) designate different sites for the same symmetric structure of HIV IN.



TARGET: LEDGFa Site of HIV Integrase
AD Exp. 109AD Exp. 110AD Exp. 111AD Exp. 112AD Exp. 113AD Exp. 114
Receptor StructureFull NCIEnamineChemBridgeAsinexVitas-MMaybridge
PDB 4GVMa, LEDGFa Site374019-374335381371-383715377315-378328375287-375793390751-392254373711-373787
PDB 4GVMb, LEDGFa Site374336-374652383716-386060378329-379342375794-376300392255-393758373788-373864
PDB 4GW6a, LEDGFa Site374653-374969386061-388405379343-380356376301-376807393759-395262373865-373941
PDB 4GW6b, LEDGFa Site374970-375286388406-390750380357-381370376808-377314395263-396766373942-374018
COMPLETION99%69%76%65%99%0%



Experiments 103-108: 84% completed

Experiments 103 to 108 (AD Vina), 84% completed

Experiments 103 through 108 target allosteric sites of HIV integrase (FBP, LEDGF, and Y3 (under the 140s residues loop) sites). These experiments involve screening 6 libraries (Full NCI, Enamine, ChemBridge, Asinex, Vitas-M) and Maybridge with AD Vina against various (receptor) structures from the PDB. These experiments complement Experiments 47 - 51, 91 - 96; however, these experiments will help distinguish better sites of among a group of receptor structures even within the same structure. For example, the HIV receptor structure containing the allosteric sites actually contains 2 sites for each of FBP, LEDGF, and Y3 pockets due to the symmetric nature of the HIV IN catalytic core domain (CCD). To help read structures in the table below, the "a" and "b" after the 4-character PDB ID designate those receptor structures with alternate residue positions, while the "a" and "b" with the sites (FBP, LEDGF, Y3) designate different sites for the same symmetric structure of HIV IN.



TARGET: FBP, LEDGF, and ,Y3 Sites of HIV Integrase
AD Exp. 103
AD Vina Exp. 55
AD Exp. 104
AD Vina Exp. 56
AD Exp. 105
AD Vina Exp. 57
AD Exp. 106
AD Vina Exp. 58
AD Exp. 107
AD Vina Exp. 59
AD Exp. 108
AD Vina Exp. 60
Receptor StructureFull NCIEnamineChemBridgeAsinexVitas-MMaybridge
PDB 3AV9a, FBPa Site281071-281102286191-286425323791-323892340111-340161348271-348421372431-372438
PDB 3AV9a, FBPb Site281103-281134286426-286660323893-323994340162-340212348422-348572372439-372446
PDB 3AV9a, LEDGFa Site281135-281166286661-286895323995-324096340213-340263348573-348723372447-372454
PDB 3AV9a, LEDGFb Site281167-281198286896-287130324097-324198340264-340314348724-348874372455-372462
PDB 3AV9a, Y3a Site281199-281230287131-287365324199-324300340315-340365348875-349025372463-372470
PDB 3AV9a, Y3b Site281231-281262287366-287600324301-324402340366-340416349026-349176372471-372478
PDB 3AV9b, FBPa Site281263-281294287601-287835324403-324504340417-340467349177-349327372479-372486
PDB 3AV9b, FBPb Site281295-281326287836-288070324505-324606340468-340518349328-349478372487-372494
PDB 3AV9b, LEDGFa Site281327-281358288071-288305324607-324708340519-340569349479-349629372495-372502
PDB 3AV9b, LEDGFb Site281359-281390288306-288540324709-324810340570-340620349630-349780372503-372510
PDB 3AV9b, Y3a Site281391-281422288541-288775324811-324912340621-340671349781-349931372511-372518
PDB 3AV9b, Y3b Site281423-281454288776-289010324913-325014340672-340722349932-350082372519-372526
PDB 3AVAa, FBPa Site281455-281486289011-289245325015-325116340723-340773350083-350233372527-372534
PDB 3AVAa, FBPb Site281487-281518289246-289480325117-325218340774-340824350234-350384372535-372542
PDB 3AVAa, LEDGFa Site281519-281550289481-289715325219-325320340825-340875350385-350535372543-372550
PDB 3AVAa, LEDGFb Site281551-281582289716-289950325321-325422340876-340926350536-350686372551-372558
PDB 3AVAa, Y3a Site281583-281614289951-290185325423-325524340927-340977350687-350837372559-372566
PDB 3AVAa, Y3b Site281615-281646290186-290420325525-325626340978-341028350838-350988372567-372574
PDB 3AVAb, FBPa Site281647-281678290421-290655325627-325728341029-341079350989-351139372575-372582
PDB 3AVAb, FBPb Site281679-281710290656-290890325729-325830341080-341130351140-351290372583-372590
PDB 3AVAb, LEDGFa Site281711-281742290891-291125325831-325932341131-341181351291-351441372591-372598
PDB 3AVAb, LEDGFb Site281743-281774291126-291360325933-326034341182-341232351442-351592372599-372606
PDB 3AVAb, Y3a Site281775-281806291361-291595326035-326136341233-341283351593-351743372607-372614
PDB 3AVAb, Y3b Site281807-281838291596-291830326137-326238341284-341334351744-351894372615-372622
PDB 3AVCa, FBPa Site281839-281870291831-292065326239-326340341335-341385351895-352045372623-372630
PDB 3AVCa, FBPb Site281871-281902292066-292300326341-326442341386-341436352046-352196372631-372638
PDB 3AVCa, LEDGFa Site281903-281934292301-292535326443-326544341437-341487352197-352347372639-372646
PDB 3AVCa, LEDGFb Site281935-281966292536-292770326545-326646341488-341538352348-352498372647-372654
PDB 3AVCa, Y3a Site281967-281998292771-293005326647-326748341539-341589352499-352649372655-372662
PDB 3AVCa, Y3b Site281999-282030293006-293240326749-326850341590-341640352650-352800372663-372670
PDB 3AVCb, FBPa Site282031-282062293241-293475326851-326952341641-341691352801-352951372671-372678
PDB 3AVCb, FBPb Site282063-282094293476-293710326953-327054341692-341742352952-353102372679-372686
PDB 3AVCb, LEDGFa Site282095-282126293711-293945327055-327156341743-341793353103-353253372687-372694
PDB 3AVCb, LEDGFb Site282127-282158293946-294180327157-327258341794-341844353254-353404372695-372702
PDB 3AVCb, Y3a Site282159-282190294181-294415327259-327360341845-341895353405-353555372703-372710
PDB 3AVCb, Y3b Site282191-282222294416-294650327361-327462341896-341946353556-353706372711-372718
PDB 3AVFa, FBPa Site282223-282254294651-294885327463-327564341947-341997353707-353857372719-372726
PDB 3AVFa, FBPb Site282255-282286294886-295120327565-327666341998-342048353858-354008372727-372734
PDB 3AVFa, LEDGFa Site282287-282318295121-295355327667-327768342049-342099354009-354159372735-372742
PDB 3AVFa, LEDGFb Site282319-282350295356-295590327769-327870342100-342150354160-354310372743-372750
PDB 3AVFa, Y3a Site282351-282382295591-295825327871-327972342151-342201354311-354461372751-372758
PDB 3AVFa, Y3b Site282383-282414295826-296060327973-328074342202-342252354462-354612372759-372766
PDB 3AVFb, FBPa Site282415-282446296061-296295328075-328176342253-342303354613-354763372767-372774
PDB 3AVFb, FBPb Site282447-282478296296-296530328177-328278342304-342354354764-354914372775-372782
PDB 3AVFb, LEDGFa Site282479-282510296531-296765328279-328380342355-342405354915-355065372783-372790
PDB 3AVFb, LEDGFb Site282511-282542296766-297000328381-328482342406-342456355066-355216372791-372798
PDB 3AVFb, Y3a Site282543-282574297001-297235328483-328584342457-342507355217-355367372799-372806
PDB 3AVFb, Y3b Site282575-282606297236-297470328585-328686342508-342558355368-355518372807-372814
PDB 3AVGa, FBPa Site282607-282638297471-297705328687-328788342559-342609355519-355669372815-372822
PDB 3AVGa, FBPb Site282639-282670297706-297940328789-328890342610-342660355670-355820372823-372830
PDB 3AVGa, LEDGFa Site282671-282702297941-298175328891-328992342661-342711355821-355971372831-372838
PDB 3AVGa, LEDGFb Site282703-282734298176-298410328993-329094342712-342762355972-356122372839-372846
PDB 3AVGa, Y3a Site282735-282766298411-298645329095-329196342763-342813356123-356273372847-372854
PDB 3AVGa, Y3b Site282767-282798298646-298880329197-329298342814-342864356274-356424372855-372862
PDB 3AVGb, FBPa Site282799-282830298881-299115329299-329400342865-342915356425-356575372863-372870
PDB 3AVGb, FBPb Site282831-282862299116-299350329401-329502342916-342966356576-356726372871-372878
PDB 3AVGb, LEDGFa Site282863-282894299351-299585329503-329604342967-343017356727-356877372879-372886
PDB 3AVGb, LEDGFb Site282895-282926299586-299820329605-329706343018-343068356878-357028372887-372894
PDB 3AVGb, Y3a Site282927-282958299821-300055329707-329808343069-343119357029-357179372895-372902
PDB 3AVGb, Y3b Site282959-282990300056-300290329809-329910343120-343170357180-357330372903-372910
PDB 3AVHa, FBPa Site282991-283022300291-300525329911-330012343171-343221357331-357481372911-372918
PDB 3AVHa, FBPb Site283023-283054300526-300760330013-330114343222-343272357482-357632372919-372926
PDB 3AVHa, LEDGFa Site283055-283086300761-300995330115-330216343273-343323357633-357783372927-372934
PDB 3AVHa, LEDGFb Site283087-283118300996-301230330217-330318343324-343374357784-357934372935-372942
PDB 3AVHa, Y3a Site283119-283150301231-301465330319-330420343375-343425357935-358085372943-372950
PDB 3AVHa, Y3b Site283151-283182301466-301700330421-330522343426-343476358086-358236372951-372958
PDB 3AVHb, FBPa Site283183-283214301701-301935330523-330624343477-343527358237-358387372959-372966
PDB 3AVHb, FBPb Site283215-283246301936-302170330625-330726343528-343578358388-358538372967-372974
PDB 3AVHb, LEDGFa Site283247-283278302171-302405330727-330828343579-343629358539-358689372975-372982
PDB 3AVHb, LEDGFb Site283279-283310302406-302640330829-330930343630-343680358690-358840372983-372990
PDB 3AVHb, Y3a Site283311-283342302641-302875330931-331032343681-343731358841-358991372991-372998
PDB 3AVHb, Y3b Site283343-283374302876-303110331033-331134343732-343782358992-359142372999-373006
PDB 3AVIa, FBPa Site283375-283406303111-303345331135-331236343783-343833359143-359293373007-373014
PDB 3AVIa, FBPb Site283407-283438303346-303580331237-331338343834-343884359294-359444373015-373022
PDB 3AVIa, LEDGFa Site283439-283470303581-303815331339-331440343885-343935359445-359595373023-373030
PDB 3AVIa, LEDGFb Site283471-283502303816-304050331441-331542343936-343986359596-359746373031-373038
PDB 3AVIa, Y3a Site283503-283534304051-304285331543-331644343987-344037359747-359897373039-373046
PDB 3AVIa, Y3b Site283535-283566304286-304520331645-331746344038-344088359898-360048373047-373054
PDB 3AVIb, FBPa Site283567-283598304521-304755331747-331848344089-344139360049-360199373055-373062
PDB 3AVIb, FBPb Site283599-283630304756-304990331849-331950344140-344190360200-360350373063-373070
PDB 3AVIb, LEDGFa Site283631-283662304991-305225331951-332052344191-344241360351-360501373071-373078
PDB 3AVIb, LEDGFb Site283663-283694305226-305460332053-332154344242-344292360502-360652373079-373086
PDB 3AVIb, Y3a Site283695-283726305461-305695332155-332256344293-344343360653-360803373087-373094
PDB 3AVIb, Y3b Site283727-283758305696-305930332257-332358344344-344394360804-360954373095-373102
PDB 3AVJa, FBPa Site283759-283790305931-306165332359-332460344395-344445360955-361105373103-373110
PDB 3AVJa, FBPb Site283791-283822306166-306400332461-332562344446-344496361106-361256373111-373118
PDB 3AVJa, LEDGFa Site283823-283854306401-306635332563-332664344497-344547361257-361407373119-373126
PDB 3AVJa, LEDGFb Site283855-283886306636-306870332665-332766344548-344598361408-361558373127-373134
PDB 3AVJa, Y3a Site283887-283918306871-307105332767-332868344599-344649361559-361709373135-373142
PDB 3AVJa, Y3b Site283919-283950307106-307340332869-332970344650-344700361710-361860373143-373150
PDB 3AVJb, FBPa Site283951-283982307341-307575332971-333072344701-344751361861-362011373151-373158
PDB 3AVJb, FBPb Site283983-284014307576-307810333073-333174344752-344802362012-362162373159-373166
PDB 3AVJb, LEDGFa Site284015-284046307811-308045333175-333276344803-344853362163-362313373167-373174
PDB 3AVJb, LEDGFb Site284047-284078308046-308280333277-333378344854-344904362314-362464373175-373182
PDB 3AVJb, Y3a Site284079-284110308281-308515333379-333480344905-344955362465-362615373183-373190
PDB 3AVJb, Y3b Site284111-284142308516-308750333481-333582344956-345006362616-362766373191-373198
PDB 3AVKa, FBPa Site284143-284174308751-308985333583-333684345007-345057362767-362917373199-373206
PDB 3AVKa, FBPb Site284175-284206308986-309220333685-333786345058-345108362918-363068373207-373214
PDB 3AVKa, LEDGFa Site284207-284238309221-309455333787-333888345109-345159363069-363219373215-373222
PDB 3AVKa, LEDGFb Site284239-284270309456-309690333889-333990345160-345210363220-363370373223-373230
PDB 3AVKa, Y3a Site284271-284302309691-309925333991-334092345211-345261363371-363521373231-373238
PDB 3AVKa, Y3b Site284303-284334309926-310160334093-334194345262-345312363522-363672373239-373246
PDB 3AVKb, FBPa Site284335-284366310161-310395334195-334296345313-345363363673-363823373247-373254
PDB 3AVKb, FBPb Site284367-284398310396-310630334297-334398345364-345414363824-363974373255-373262
PDB 3AVKb, LEDGFa Site284399-284430310631-310865334399-334500345415-345465363975-364125373263-373270
PDB 3AVKb, LEDGFb Site284431-284462310866-311100334501-334602345466-345516364126-364276373271-373278
PDB 3AVKb, Y3a Site284463-284494311101-311335334603-334704345517-345567364277-364427373279-373286
PDB 3AVKb, Y3b Site284495-284526311336-311570334705-334806345568-345618364428-364578373287-373294
PDB 3AVLa, FBPa Site284527-284558311571-311805334807-334908345619-345669364579-364729373295-373302
PDB 3AVLa, FBPb Site284559-284590311806-312040334909-335010345670-345720364730-364880373303-373310
PDB 3AVLa, LEDGFa Site284591-284622312041-312275335011-335112345721-345771364881-365031373311-373318
PDB 3AVLa, LEDGFb Site284623-284654312276-312510335113-335214345772-345822365032-365182373319-373326
PDB 3AVLa, Y3a Site284655-284686312511-312745335215-335316345823-345873365183-365333373327-373334
PDB 3AVLa, Y3b Site284687-284718312746-312980335317-335418345874-345924365334-365484373335-373342
PDB 3AVLb, FBPa Site284719-284750312981-313215335419-335520345925-345975365485-365635373343-373350
PDB 3AVLb, FBPb Site284751-284782313216-313450335521-335622345976-346026365636-365786373351-373358
PDB 3AVLb, LEDGFa Site284783-284814313451-313685335623-335724346027-346077365787-365937373359-373366
PDB 3AVLb, LEDGFb Site284815-284846313686-313920335725-335826346078-346128365938-366088373367-373374
PDB 3AVLb, Y3a Site284847-284878313921-314155335827-335928346129-346179366089-366239373375-373382
PDB 3AVLb, Y3b Site284879-284910314156-314390335929-336030346180-346230366240-366390373383-373390
PDB 3AVMa, FBPa Site284911-284942314391-314625336031-336132346231-346281366391-366541373391-373398
PDB 3AVMa, FBPb Site284943-284974314626-314860336133-336234346282-346332366542-366692373399-373406
PDB 3AVMa, LEDGFa Site284975-285006314861-315095336235-336336346333-346383366693-366843373407-373414
PDB 3AVMa, LEDGFb Site285007-285038315096-315330336337-336438346384-346434366844-366994373415-373422
PDB 3AVMa, Y3a Site285039-285070315331-315565336439-336540346435-346485366995-367145373423-373430
PDB 3AVMa, Y3b Site285071-285102315566-315800336541-336642346486-346536367146-367296373431-373438
PDB 3AVMb, FBPa Site285103-285134315801-316035336643-336744346537-346587367297-367447373439-373446
PDB 3AVMb, FBPb Site285135-285166316036-316270336745-336846346588-346638367448-367598373447-373454
PDB 3AVMb, LEDGFa Site285167-285198316271-316505336847-336948346639-346689367599-367749373455-373462
PDB 3AVMb, LEDGFb Site285199-285230316506-316740336949-337050346690-346740367750-367900373463-373470
PDB 3AVMb, Y3a Site285231-285262316741-316975337051-337152346741-346791367901-368051373471-373478
PDB 3AVMb, Y3b Site285263-285294316976-317210337153-337254346792-346842368052-368202373479-373486
PDB 3AVNa, FBPa Site285295-285326317211-317445337255-337356346843-346893368203-368353373487-373494
PDB 3AVNa, FBPb Site285327-285358317446-317680337357-337458346894-346944368354-368504373495-373502
PDB 3AVNa, LEDGFa Site285359-285390317681-317915337459-337560346945-346995368505-368655373503-373510
PDB 3AVNa, LEDGFb Site285391-285422317916-318150337561-337662346996-347046368656-368806373511-373518
PDB 3AVNa, Y3a Site285423-285454318151-318385337663-337764347047-347097368807-368957373519-373526
PDB 3AVNa, Y3b Site285455-285486318386-318620337765-337866347098-347148368958-369108373527-373534
PDB 3AVNb, FBPa Site285487-285518318621-318855337867-337968347149-347199369109-369259373535-373542
PDB 3AVNb, FBPb Site285519-285550318856-319090337969-338070347200-347250369260-369410373543-373550
PDB 3AVNb, LEDGFa Site285551-285582319091-319325338071-338172347251-347301369411-369561373551-373558
PDB 3AVNb, LEDGFb Site285583-285614319326-319560338173-338274347302-347352369562-369712373559-373566
PDB 3AVNb, Y3a Site285615-285646319561-319795338275-338376347353-347403369713-369863373567-373574
PDB 3AVNb, Y3b Site285647-285678319796-320030338377-338478347404-347454369864-370014373575-373582
PDB 4GVMa, FBPa Site285679-285710320031-320265338479-338580347455-347505370015-370165373583-373590
PDB 4GVMa, FBPb Site285711-285742320266-320500338581-338682347506-347556370166-370316373591-373598
PDB 4GVMa, LEDGFa Site285743-285774320501-320735338683-338784347557-347607370317-370467373599-373606
PDB 4GVMa, LEDGFb Site285775-285806320736-320970338785-338886347608-347658370468-370618373607-373614
PDB 4GVMb, FBPa Site285807-285838320971-321205338887-338988347659-347709370619-370769373615-373622
PDB 4GVMb, FBPb Site285839-285870321206-321440338989-339090347710-347760370770-370920373623-373630
PDB 4GVMb, LEDGFa Site285871-285902321441-321675339091-339192347761-347811370921-371071373631-373638
PDB 4GVMb, LEDGFb Site285903-285934321676-321910339193-339294347812-347862371072-371222373639-373646
PDB 4GW6a, FBPa Site285935-285966321911-322145339295-339396347863-347913371223-371373373647-373654
PDB 4GW6a, FBPb Site285967-285998322146-322380339397-339498347914-347964371374-371524373655-373662
PDB 4GW6a, LEDGFa Site285999-286030322381-322615339499-339600347965-348015371525-371675373663-373670
PDB 4GW6a, LEDGFb Site286031-286062322616-322850339601-339702348016-348066371676-371826373671-373678
PDB 4GW6b, FBPa Site286063-286094322851-323085339703-339804348067-348117371827-371977373679-373686
PDB 4GW6b, FBPb Site286095-286126323086-323320339805-339906348118-348168371978-372128373687-373694
PDB 4GW6b, LEDGFa Site286127-286158323321-323555339907-340008348169-348219372129-372279373695-373702
PDB 4GW6b, LEDGFb Site286159-286190323556-323790340009-340110348220-348270372280-372430373703-373710
COMPLETION83%90%34%100%99.9%99.8%



Experiment Status Navigation

1 - 18 / 19 - 38 / 39 - 71 / 72 - 102 / 103 - 120 / 121 - 172

Corresponding Batches
1-3702 / 4000-26810 / 26811-97214 / 97215-281070 / 281071-552394 / 552395-954685


Results of these FightAIDS@Home experiments are available to the public as raw, unprocessed AutoDock dlg files upon request. E-mail Dr. Daniel N. Santiago = dsantiag ]~[ scripps . edu (use the @ symbol to replace the ]~[ and remove the spaces) for further information. Please include the phrase "FAAH data" in the subject line of your e-mail. Since the amount of data is on the order of many terabytes, you will need to provide suitable media (such as external hard drives) for receiving a copy of these results.




Image above of an ensemble of target conformations of the G140S/Q148H drug-resistant mutant of HIV integrase was created by Alex Perryman.

Created by Dr. Garrett M. Morris and curated by Dr. Alex L. Perryman from 2007 to August, 2013. Now curated by Dr. Daniel N. Santiago. The HIVE logo above was created by Dr. Stefano Forli.

Last modified: 03/19/2014 by Daniel N. Santiago, Ph.D.


©2003-2014 The Olson Laboratory, The Scripps Research Institute, All Rights Reserved.